Crystallography Open Database

Information card for entry 7241219

Preview

Coordinates	7241219.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H58 Mn6 N8 O27
Calculated formula	C62 H58 Mn6 N8 O27
Title of publication	Two 3D Mn-based coordination polymers: synthesis, structure and magnetocaloric effect
Authors of publication	Li, Ning-Fang; Han, Ye-Min; Li, Jia-Nian; Cao, Jia-Peng; Du, Ze-Yu; Xu, Yan
Journal of publication	RSC Advances
Year of publication	2020
Journal volume	10
Journal issue	56
Pages of publication	33628 - 33634
a	15.513 ± 0.002 Å
b	10.486 ± 0.002 Å
c	22.374 ± 0.004 Å
α	90°
β	107.311 ± 0.003°
γ	90°
Cell volume	3474.7 ± 1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0308
Residual factor for significantly intense reflections	0.0268
Weighted residual factors for significantly intense reflections	0.067
Weighted residual factors for all reflections included in the refinement	0.0692
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
258020 (current)	2020-10-06	cif/ Updating files of 7241218, 7241219 Original log message: Adding full bibliography for 7241218--7241219.cif.	7241219.cif
256341	2020-09-11	cif/ Adding structures of 7241218, 7241219 via cif-deposit CGI script.	7241219.cif